BindingDB logo
myBDB logout

BDBM194218 US9200001, 134

SMILES: Cc1nc(C)n(n1)-c1cc(nc(n1)N1CC[C@@H](F)C1)[C@@H]1C[C@H]1c1nc2ccccc2n1C

InChI Key: InChIKey=JVNSJOMOSKNWOV-BRWVUGGUSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 194218   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Isoform PDE10A2 of cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A (PDE10A2)


(Homo sapiens (Human))
BDBM194218
PNG
(US9200001, 134)
Show SMILES Cc1nc(C)n(n1)-c1cc(nc(n1)N1CC[C@@H](F)C1)[C@@H]1C[C@H]1c1nc2ccccc2n1C |r|
Show InChI InChI=1S/C23H25FN8/c1-13-25-14(2)32(29-13)21-11-19(27-23(28-21)31-9-8-15(24)12-31)16-10-17(16)22-26-18-6-4-5-7-20(18)30(22)3/h4-7,11,15-17H,8-10,12H2,1-3H3/t15-,16-,17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
0.580n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
In a typical experiment the PDE10 inhibitory activity of the compounds of the present invention was determined in accordance with the following exp...


US Patent US9200001 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01M3
More data for this
Ligand-Target Pair